1-[4-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]sulfonyl]phenyl]pyrrolidin-2-one

Systemtic Name: 1-[4-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]sulfonyl]phenyl]pyrrolidin-2-one Openeye Name: 1-[4-[[4-(p-tolylsulfonyl)-1,4-diazepan-1-yl]sulfonyl]phenyl]pyrrolidin-2-one CAS Name: 1-[4-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]sulfonyl]phenyl]-2-pyrrolidinone IUPAC Name: 1-[4-[[4-(4-methylphenyl)sulfonyl-1,4-diazepan-1-yl]sulfonyl]phenyl]pyrrolidin-2-one Traditional Name: 1-[4-[(4-tosyl-1,4-diazepan-1-yl)sulfonyl]phenyl]-2-pyrrolidone Formula: C22H27N3O5S2 MolecularWeight: 477.59688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)N4CCCC4=O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCCN(CC2)S(=O)(=O)C3=CC=C(C=C3)N4CCCC4=O

InChI

InChI=1S/C22H27N3O5S2/c1-18-5-9-20(10-6-18)31(27,28)23-13-3-14-24(17-16-23)32(29,30)21-11-7-19(8-12-21)25-15-2-4-22(25)26/h5-12H,2-4,13-17H2,1H3